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Substance Name: 1-Fluoro-25-hydroxyvitamin D3
RN: 74041-09-1
InChIKey: ARPWBNOBVVRSKQ-XDJVCPMGSA-N

Molecular Weight

  • 418.633
 
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Names and Synonyms

Name of Substance

  • 1-Fluoro-25-hydroxyvitamin D3

Synonyms

  • 1alpha-Fluoro-25-hydroxycholecalciferol
  • 1alpha-Fluorocalcifediol

Registry Numbers

CAS Registry Number

  • 74041-09-1

System Generated Number

  • 0074041091

Structure Descriptors

InChI

1S/C27H43FO2/c1-18(8-6-14-26(3,4)30)23-12-13-24-20(9-7-15-27(23,24)5)10-11-21-16-22(29)17-25(28)19(21)2/h10-11,18,22-25,29-30H,2,6-9,12-17H2,1,3-5H3/b20-10+,21-11-/t18-,22+,23-,24+,25?,27-/m1/s1

InChIKey

ARPWBNOBVVRSKQ-XDJVCPMGSA-N

Smiles

C1[C@H](C\C(=C\C=C2\[C@@H]3CC[C@@H]([C@@H](CCCC(C)(C)O)C)[C@@]3(C)CCC2)C([C@@H]1F)=C)O